SCHEMBL21033150

SCHEMBL21033150

CCC(=O)c1nn2ccc(C)nc2c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 4/20 0.39
▸ PTGS2 P35354 2/20 0.38
▸ TYK2 P29597 1/20 0.35
▸ PDE2A O00408 1/20 0.33
▸ RIPK1 Q13546 2/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ PKM P14618 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ABCC4 O15439 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ DPP4 P27487 3/20 0.31
▸ FAP Q12884 3/20 0.31
▸ DPP8 Q6V1X1 3/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ NFKB1 P19838 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21033308 0.84 HTR6 (0.41) HTR6PTGS2TYK2KMT2ALMNA
SCHEMBL21001663 0.80 KDM4E (0.45) HTR6PTGS2TYK2PDE2AKMT2A
SCHEMBL18122086 0.73 HTR6 (0.43) HTR6PTGS2TYK2DPP4FAP
SCHEMBL17883350 0.70 HTR6 (0.38) HTR6PTGS2TYK2LMNAPKM
SCHEMBL8353834 0.69 ADORA3 (0.40) PTGS2LMNAPTGS1KDM4ECYP1A2
SCHEMBL24066067 0.66 HTR6 (0.36) HTR6PTGS2TYK2PDE2A
SCHEMBL18208948 0.65 POLB (0.42) HTR6PTGS2KMT2ALMNAPKM
SCHEMBL23013906 0.64 HTT (0.43) KMT2ALMNAMEN1KDM4ECYP1A2
SCHEMBL21033227 0.64 TGFBR1 (0.35) KMT2ALMNADPP4FAPDPP8
SCHEMBL4940329 0.64 NTRK1 (0.42) HTR6PTGS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019102494-A1 HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS JUBILANT BIOSYS LIMITED (IN) 2019-05-31 — — WO disclosed
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